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3-(4-Chlorobenzyl)-N-(2,5-dimethylphenyl)succinamic acid

View entire compound with spectra: 1 NMR

3-(4-Chlorobenzyl)-N-(2,5-dimethylphenyl)succinamic acid
SpectraBase Compound ID HrcCEzPzBMo
InChI InChI=1S/C19H20ClNO3/c1-12-3-4-13(2)17(9-12)21-19(24)15(11-18(22)23)10-14-5-7-16(20)8-6-14/h3-9,15H,10-11H2,1-2H3,(H,21,24)(H,22,23)
InChIKey SFQODLJFJVFFPZ-UHFFFAOYSA-N
Mol Weight 345.83 g/mol
Molecular Formula C19H20ClNO3
Exact Mass 345.113171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JQNIft5UdbA
Name 3-(4-Chlorobenzyl)-N-(2,5-dimethylphenyl)succinamic acid
Comments Computed using HOSE algorithm
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Exact Mass 345.113171205 u
Formula C19H20ClNO3
InChI InChI=1S/C19H20ClNO3/c1-12-3-4-13(2)17(9-12)21-19(24)15(11-18(22)23)10-14-5-7-16(20)8-6-14/h3-9,15H,10-11H2,1-2H3,(H,21,24)(H,22,23)
InChIKey SFQODLJFJVFFPZ-UHFFFAOYSA-N
Molecular Weight 345.826 g/mol
SMILES C1=CC(=CC=C1CC(CC(=O)O)C(NC1=CC(=CC=C1C)C)=O)Cl